4 Lattice="3.0 0.0 0.0 0.0 3.0 0.0 0.0 0.0 3.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=2.101682767160826 stress="-1.7851833368098406 -0.08672718033570129 0.042545941215210534 -0.08672718033570129 -1.6831769672799612 -0.14098310007580908 0.042545941215210534 -0.14098310007580908 -2.1868331468367876" pbc="T F T" Fe 0.03848316 0.19178619 0.17895518 8.54178162 -16.89193867 -10.14175089 Fe 1.79140871 1.61455359 0.03253581 -13.36803257 14.57275355 -2.42141659 Fe 1.64904689 0.10609294 1.46603997 -13.08828284 -18.17544710 5.71137717 Fe -0.19401975 1.32157598 1.51361598 17.91453379 20.49463222 6.85179031